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(Z)-2-[3-(4-METHOXYPHENYL)-1-PHENYLPYRAZOL-5-YL]-3-(3,4-DIFLUOROPHENYL)-ACRYLONITRILE
SpectraBase Compound ID AyGT589M3Y0
InChI InChI=1S/C25H17F2N3O/c1-31-21-10-8-18(9-11-21)24-15-25(30(29-24)20-5-3-2-4-6-20)19(16-28)13-17-7-12-22(26)23(27)14-17/h2-15H,1H3/b19-13+
InChIKey VZKZZZSIGCZOPZ-CPNJWEJPSA-N
Mol Weight 413.43 g/mol
Molecular Formula C25H17F2N3O
Exact Mass 413.133969 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EQlVlkZ9aRD
Name (Z)-2-[3-(4-METHOXYPHENYL)-1-PHENYLPYRAZOL-5-YL]-3-(3,4-DIFLUOROPHENYL)-ACRYLONITRILE
Compound Number 42
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H17F2N3O
InChI InChI=1S/C25H17F2N3O/c1-31-21-10-8-18(9-11-21)24-15-25(30(29-24)20-5-3-2-4-6-20)19(16-28)13-17-7-12-22(26)23(27)14-17/h2-15H,1H3/b19-13+
InChIKey VZKZZZSIGCZOPZ-CPNJWEJPSA-N
Literature Reference Author V.S.PARMAR,N.K.SHARMA,M.HUSAIN,A.C.WATTERSON,J.KUMAR,L.A.SAM UELSON,A.L.CHOLLI,A.
Literature Reference Citation BIOORG.MED.CHEM.,11,913(2003)
Literature Reference DOI 10.1016/S0968-0896(02)00539-4
Molecular Weight 413.426 g/mol
Sample ID 38574
Solvent CDCl3